(2S)-1-methoxy-N-methylhexan-2-amine

C8H19NO — CID 177242292

IUPAC(2S)-1-methoxy-N-methylhexan-2-amine
SMILESCCCC[C@@H](COC)NC
InChIInChI=1S/C8H19NO/c1-4-5-6-8(9-2)7-10-3/h8-9H,4-7H2,1-3H3/t8-/m0/s1
InChIKeyKSLIVJFWGODXAR-QMMMGPOBSA-N
MW145.25 g/mol
LogP1.41
Rot. Bonds6

About (2S)-1-methoxy-N-methylhexan-2-amine

(2S)-1-methoxy-N-methylhexan-2-amine (PubChem CID 177242292) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is (2S)-1-methoxy-N-methylhexan-2-amine.

Molecular Properties

Compound Name(2S)-1-methoxy-N-methylhexan-2-amine
PubChem CID177242292
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name(2S)-1-methoxy-N-methylhexan-2-amine
SMILESCCCC[C@@H](COC)NC
InChIInChI=1S/C8H19NO/c1-4-5-6-8(9-2)7-10-3/h8-9H,4-7H2,1-3H3/t8-/m0/s1
InChIKeyKSLIVJFWGODXAR-QMMMGPOBSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-N-methyl-5-propoxypentan-2-amine
CID 106454502
1-methoxy-N,7-dimethyloctan-2-amine
CID 83158137
6-ethoxy-1-methoxy-N-methylhexan-2-amine
CID 65180928
1-hexoxy-3-methoxy-N-methylpropan-2-amine
CID 107506726
1-butoxy-5-methoxy-N-methylpentan-3-amine
CID 114998768
1,3-dimethoxy-N-methylpropan-2-amine;ethane
CID 171819113
1-methoxy-N-(4-methoxybutyl)hexan-2-amine
CID 115709746
2-(1-methoxyhexan-2-ylamino)-N-methylacetamide
CID 115706822
1-ethoxy-N-methyltridecan-2-amine
CID 105008040
1-methoxytetradecan-2-ylhydrazine
CID 105207172
1-methoxyoctan-2-ylhydrazine
CID 105207304
N-ethyl-1-methoxydecan-2-amine
CID 62320563

Frequently Asked Questions

What is the IUPAC name of (2S)-1-methoxy-N-methylhexan-2-amine?
The IUPAC name of (2S)-1-methoxy-N-methylhexan-2-amine (CID 177242292) is (2S)-1-methoxy-N-methylhexan-2-amine.
What is the SMILES notation for (2S)-1-methoxy-N-methylhexan-2-amine?
The canonical SMILES for (2S)-1-methoxy-N-methylhexan-2-amine is CCCC[C@@H](COC)NC.
What is the InChIKey of (2S)-1-methoxy-N-methylhexan-2-amine?
The InChIKey is KSLIVJFWGODXAR-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H19NO/c1-4-5-6-8(9-2)7-10-3/h8-9H,4-7H2,1-3H3/t8-/m0/s1.
What are the key properties of (2S)-1-methoxy-N-methylhexan-2-amine?
(2S)-1-methoxy-N-methylhexan-2-amine has a molecular weight of 145.25 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-methoxy-N-methylhexan-2-amine is sourced from PubChem (CID 177242292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).